(2R)-2-[3-(7-methoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)propanoylamino]hexanoate

Systemtic Name: (2R)-2-[3-(7-methoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)propanoylamino]hexanoate Openeye Name: (2R)-2-[3-(7-methoxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoylamino]hexanoate CAS Name: (2R)-2-[[3-(7-methoxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]hexanoate IUPAC Name: (2R)-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]hexanoate Traditional Name: (2R)-2-[3-(2-keto-7-methoxy-4,8-dimethyl-chromen-3-yl)propanoylamino]hexanoate Formula: C21H26NO6- MolecularWeight: 388.43424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])NC(=O)CCC1=C(C2=C(C(=C(C=C2)OC)C)OC1=O)C

Isomeric SMILES

CCCC[C@H](C(=O)[O-])NC(=O)CCC1=C(C2=C(C(=C(C=C2)OC)C)OC1=O)C

InChI

InChI=1S/C21H27NO6/c1-5-6-7-16(20(24)25)22-18(23)11-9-15-12(2)14-8-10-17(27-4)13(3)19(14)28-21(15)26/h8,10,16H,5-7,9,11H2,1-4H3,(H,22,23)(H,24,25)/p-1/t16-/m1/s1